Chemical Component Summary

Name1-thio-beta-D-glucopyranose
Synonyms1-thio-beta-D-glucose; 1-thio-D-glucose; 1-thio-glucose
Identifiers(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-sulfanyl-oxane-3,4,5-triol
FormulaC6 H12 O5 S
Molecular Weight196.221
TypeD-SACCHARIDE, BETA LINKING
Isomeric SMILESC([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)S)O)O)O)O
InChIInChI=1S/C6H12O5S/c7-1-2-3(8)4(9)5(10)6(12)11-2/h2-10,12H,1H2/t2-,3-,4+,5-,6+/m1/s1
InChIKeyJUSMHIGDXPKSID-DVKNGEFBSA-N

Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count5
Bond Count24
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB03859 
Name1-thio-beta-D-glucopyranose
Groups experimental
Synonyms
  • β-D-Glc-SH
  • 1-thio-beta-D-glucopyranose
  • beta-D-Thioglucose
  • 1-thio-β-D-glucose
  • 1-thio-b-D-glucose
Categories
  • Carbohydrates
  • Hexoses
  • Monosaccharides
CAS number7534-35-2

Drug Targets

NameTarget SequencePharmacological ActionActions
Endoglucanase GMLKTKRKLTKAIGVALSISILSSLVSFIPQTNTYAAGTYNYGEALQKSIM...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 444809
ChEMBL CHEMBL132376
ChEBI CHEBI:42896